UCSF

ZINC32786843

Substance Information

In ZINC since Heavy atoms Benign functionality
May 9th, 2009 28 No

Download: MOL2 SDF SMILES Flexibase

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.02 5.56 -27.47 2 8 0 106 399.476 4
Hi High (pH 8-9.5) 2.02 5.85 -66.67 1 8 -1 108 398.468 4

Activity (Go SEA)

Analogs ( Draw Identity 99% 90% 80% 70% )